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Details

Stereochemistry ACHIRAL
Molecular Formula C14H11Cl2NO3
Molecular Weight 312.1484
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-HYDROXYDICLOFENAC

SMILES

c1cc(c(c(c1)Cl)Nc2ccc(cc2CC(=O)O)O)Cl

InChI

InChIKey=VNQURRWYKFZKJZ-UHFFFAOYSA-N
InChI=1S/C14H11Cl2NO3/c15-10-2-1-3-11(16)14(10)17-12-5-4-9(18)6-8(12)7-13(19)20/h1-6,17-18H,7H2,(H,19,20)

HIDE SMILES / InChI

Molecular Formula C14H11Cl2NO3
Molecular Weight 312.1484
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Diclofenac-induced inactivation of CYP3A4 and its stimulation by quinidine.
2002 Oct
Residue analysis of the pharmaceutical diclofenac in different water types using ELISA and GC-MS.
2003 Aug 1
Diclofenac-induced antibodies against red blood cells are heterogeneous and recognize different epitopes.
2004 Aug
Effects of phenobarbital on metabolism and toxicity of diclofenac sodium in rat hepatocytes in vitro.
2004 Oct
Efficient high performance liquid chromatograph/ultraviolet method for determination of diclofenac and 4'-hydroxydiclofenac in rat serum.
2006 Jan 18
Diclofenac oxidation by biogenic manganese oxides.
2010 May 1
Diclofenac hypersensitivity: antibody responses to the parent drug and relevant metabolites.
2010 Oct 28
Removal of diclofenac and mefenamic acid by the white rot fungus Phanerochaete sordida YK-624 and identification of their metabolites after fungal transformation.
2010 Sep
Human NAD(P)H:quinone oxidoreductase 1 (NQO1)-mediated inactivation of reactive quinoneimine metabolites of diclofenac and mefenamic acid.
2014 Apr 21
One-electron oxidation of diclofenac by human cytochrome P450s as a potential bioactivation mechanism for formation of 2'-(glutathion-S-yl)-deschloro-diclofenac.
2014 Jan 25
Patents
Substance Class Chemical
Created
by admin
on Sat Jun 26 01:30:24 UTC 2021
Edited
by admin
on Sat Jun 26 01:30:24 UTC 2021
Record UNII
GS38436703
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-HYDROXYDICLOFENAC
Common Name English
HYDROXYDICLOFENAC, 5-
Common Name English
BENZENEACETIC ACID, 2-((2,6-DICHLOROPHENYL)AMINO)-5-HYDROXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
3052566
Created by admin on Sat Jun 26 01:30:25 UTC 2021 , Edited by admin on Sat Jun 26 01:30:25 UTC 2021
PRIMARY
CAS
69002-84-2
Created by admin on Sat Jun 26 01:30:24 UTC 2021 , Edited by admin on Sat Jun 26 01:30:24 UTC 2021
PRIMARY
FDA UNII
GS38436703
Created by admin on Sat Jun 26 01:30:25 UTC 2021 , Edited by admin on Sat Jun 26 01:30:25 UTC 2021
PRIMARY
EPA CompTox
69002-84-2
Created by admin on Sat Jun 26 01:30:24 UTC 2021 , Edited by admin on Sat Jun 26 01:30:24 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
CYP3A4 is responsible for the formation of minor metabolites, 5-hydroxy and 3'-hydroxy-diclofenac
MINOR